cyclopenta-1,3-diene; 2-methylbutan-2-olate; titanium(4+)

Systemtic Name: cyclopenta-1,3-diene; 2-methylbutan-2-olate; titanium(4+) Openeye Name: cyclopenta-1,3-diene; 2-methylbutan-2-olate; titanium(4+) CAS Name: cyclopenta-1,3-diene; 2-methyl-2-butanolate; titanium(4+) IUPAC Name: cyclopenta-1,3-diene; 2-methylbutan-2-olate; titanium(4+) Traditional Name: cyclopenta-1,3-diene; 2-methylbutan-2-olate; titanium(4+) Formula: C20H38O3Ti MolecularWeight: 374.38092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)[O-].CCC(C)(C)[O-].CCC(C)(C)[O-].C1C=CC=[C-]1.[Ti+4]

Isomeric SMILES

CCC(C)(C)[O-].CCC(C)(C)[O-].CCC(C)(C)[O-].C1C=CC=[C-]1.[Ti+4]

InChI

InChI=1S/3C5H11O.C5H5.Ti/c3*1-4-5(2,3)6;1-2-4-5-3-1;/h3*4H2,1-3H3;1-3H,4H2;/q4*-1;+4